Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-
TL;DR: Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- (CAS 102583-77-7) is a chemical compound with molecular formula C10H12N2OS and molecular weight 208.06703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-methylsulfanylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Also Known As: 2-(m-Methylthioanilino)-2-oxazoline, 4,5-Dihydro-2-(m-(methylthio)anilino)oxazole, ANILINE, 3-(METHYLTHIO)-N-(2-OXAZOLIN-2-YL)-, n-[3-(methylsulfanyl)phenyl]-4,5-dihydro-1,3-oxazol-2-amine, N-(3-methylsulfanylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Technical Specifications
| Molecular Formula | C10H12N2OS |
| Molecular Weight | 208.06703 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.06703 Da |
| Heavy Atoms | 14 |
| Complexity | 220.0 |
| SMILES | CSC1=CC=CC(=C1)NC2=NCCO2 |
| InChIKey | PGERESVFZXINFY-UHFFFAOYSA-N |
Chemical Property Profile of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-
Property Insights of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-. With a topological polar surface area (TPSA) of 58.9 Ų, Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-?
The CAS number of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- is 102583-77-7.
What is the molecular formula of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-?
The molecular formula of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- is C10H12N2OS.
What is the molecular weight of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-?
The molecular weight of Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- is 208.06703 g/mol.
Where can I buy Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-?
You can request a quote for Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)-?
Yes, CoreyChem provides custom synthesis services for Aniline, 3-(methylthio)-N-(2-oxazolin-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.